[2-(4-methylphenyl)-3-oxidanylidene-cyclopenten-1-yl] 6-chloranylhexanoate

Systemtic Name: [2-(4-methylphenyl)-3-oxidanylidene-cyclopenten-1-yl] 6-chloranylhexanoate Openeye Name: [3-oxo-2-(p-tolyl)cyclopenten-1-yl] 6-chlorohexanoate CAS Name: 6-chlorohexanoic acid [2-(4-methylphenyl)-3-oxo-1-cyclopentenyl] ester IUPAC Name: [2-(4-methylphenyl)-3-oxocyclopenten-1-yl] 6-chlorohexanoate Traditional Name: 6-chlorohexanoic acid [3-keto-2-(p-tolyl)cyclopenten-1-yl] ester Formula: C18H21ClO3 MolecularWeight: 320.81054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(CCC2=O)OC(=O)CCCCCCl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(CCC2=O)OC(=O)CCCCCCl

InChI

InChI=1S/C18H21ClO3/c1-13-6-8-14(9-7-13)18-15(20)10-11-16(18)22-17(21)5-3-2-4-12-19/h6-9H,2-5,10-12H2,1H3